ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005389
RECORD_TITLE: 12-FLUORODODECYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAOKA R, KYOTO INSTITUTE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: 12-FLUORODODECYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H27FO2
CH$EXACT_MASS: 246.19951
CH$SMILES: FCCCCCCCCCCCCOC(C)=O
CH$IUPAC: InChI=1S/C14H27FO2/c1-14(16)17-13-11-9-7-5-3-2-4-6-8-10-12-15/h2-13H2,1H3
CH$LINK: INCHIKEY GJRKOAXTXXIFAH-UHFFFAOYSA-N
AC$INSTRUMENT: SHIMADZU QP-1000
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-02ai-9300000000-77b0ee140c8c6850341f
PK$NUM_PEAK: 79
PK$PEAK: m/z int. rel.int.
  43 2.3 23
  44 52.6 526
  45 2.9 29
  46 0.41 4
  54 10 100
  55 30.5 305
  56 51.5 515
  57 2.34 23
  58 7.3 73
  59 3.3 33
  60 1.5 15
  61 99.99 999
  63 2.4 24
  66 1.7 17
  67 13.1 131
  68 4.24 42
  69 53.4 534
  70 52.8 528
  71 13.3 133
  72 0.21 2
  73 8.6 86
  74 8.5 85
  75 2.4 24
  81 1.5 15
  82 48.3 483
  83 64.2 642
  84 30.9 309
  85 0.64 6
  86 1.5 15
  87 5 50
  88 16 160
  89 0.69 7
  95 14.2 142
  96 21.5 215
  97 55.9 559
  98 2.92 29
  99 2.8 28
  100 2.4 24
  101 11.2 112
  102 2.17 22
  103 5.3 53
  109 18.5 185
  110 9.7 97
  111 3.23 32
  112 10.2 102
  113 1.6 16
  114 7.8 78
  115 1.18 12
  116 54.3 543
  117 6.2 62
  122 1.9 19
  123 1.58 16
  124 6 60
  125 14.5 145
  126 2.8 28
  127 0.13 1
  128 8.1 81
  129 22.5 225
  130 26.7 267
  131 0.39 4
  133 2.8 28
  136 1.1 11
  137 9.9 99
  138 0.4 4
  139 1.7 17
  142 4.3 43
  143 10.5 105
  144 1.4 14
  145 2.2 22
  156 3.1 31
  157 10.9 109
  158 5.53 55
  159 6.8 68
  166 1.7 17
  174 2.4 24
  184 0.14 1
  185 1.7 17
  186 18.3 183
  187 3.3 33
//
